In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 18 | No |
Popular Name: (E)-3-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]prop-2-enoic (E)-3-[4-(1H-1,2,4-triazol-5-yls…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.88 | 8.45 | -50.62 | 1 | 5 | -1 | 82 | 260.298 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.